Molecule ID: mol8921
SMILES: O=[N+]([O-])C(F)[N+](=O)[O-]
InChI: InChI=1S/CHFN2O4/c2-1(3(5)6)4(7)8/h1H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.37 | IUPAC digitized pKa | 0 » -1 |
| 6.99 | IUPAC digitized pKa | 0 » -1 |
| 7.70 | IUPAC digitized pKa | 0 » -1 |
| 7.70 | AttenGpKa training set | 0 » -1 |
| 8.31 | IUPAC digitized pKa | 0 » -1 |